methyl 2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-chloro-4,6-dimethyl-phenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-4,6-dimethylphenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H19ClN2O2S2 MolecularWeight: 382.92796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)OC)C

InChI

InChI=1S/C17H19ClN2O2S2/c1-8-6-9(2)14(12(18)7-8)19-17(23)20-15-13(16(21)22-5)10(3)11(4)24-15/h6-7H,1-5H3,(H2,19,20,23)